Name |
Ajugareptansin (-)-Ajugareptansin |
Formula |
C29H44O10 |
Mw |
552.29344763 |
CAS RN |
72160-84-0 |
C_ID |
C00040865
,
|
InChIKey |
YKWBDFBNTYGFFZ-GEBBHFCLNA-N |
InChICode |
InChI=1S/C29H44O10/c1-7-15(2)25(33)38-20-12-21(32)29(14-36-29)28(13-35-17(4)30)23(37-18(5)31)10-16(3)27(6,24(20)28)22-11-19-8-9-34-26(19)39-22/h15-16,19-24,26,32H,7-14H2,1-6H3/t15-,16-,19-,20-,21+,22+,23+,24-,26+,27-,28-,29-/m1/s1 |
SMILES |
[C@H]1(C[C@@H]([C@@]2([C@@H]([C@]1([C@@H]1C[C@@H]3[C@H](O1)OCC3)C)[C@@H](C[C@@H]([C@]12OC1)O)OC(=O)[C@H](C)CC)COC(=O)C)OC(=O)C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Labiatae | Ajuga reptans | Ref. |
|
|
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